SCHEMBL13808564

SCHEMBL13808564

O=C1OC(O)Cc2c(O)cccc21

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PTPRF P10586 1/20 0.47
CYP19A1 P11511 4/20 0.43
PARP1 P09874 1/20 0.42
MAOA P21397 5/20 0.41
ADORA3 P0DMS8 1/20 0.41
AR P10275 1/20 0.41
HSD11B1 P28845 1/20 0.41
AKR1C3 P42330 1/20 0.41
MAOB P27338 4/20 0.40
SMN1; SMN2 Q16637 2/20 0.38
ALDH1A1 P00352 1/20 0.38
LMNA P02545 1/20 0.38
MAPT P10636 1/20 0.38
HPGD P15428 1/20 0.38
ALOX15 P16050 1/20 0.38
TSHR P16473 1/20 0.38
MAPK1 P28482 1/20 0.38
HTT P42858 1/20 0.38
HSD17B10 Q99714 1/20 0.38
TDP1 Q9NUW8 1/20 0.38

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL13851545 0.82 MAOA (0.63) MAOAMAOBMAPT
SCHEMBL9000108 0.80 PTPRF (0.46) PTPRFMAOAMAOBSMN1; SMN2MAPT
SCHEMBL4006708 0.78 MAOA (0.40) PTPRFCYP19A1PARP1MAOAADORA3
SCHEMBL3999560 0.76 CYP19A1 (0.51) CYP19A1PARP1MAOAMAOBSMN1; SMN2
SCHEMBL1072092 0.73 SMN1; SMN2 (0.61) PTPRFMAOAMAOBSMN1; SMN2ALDH1A1
SCHEMBL13115609 0.72 ACHE (0.68) CYP19A1PARP1MAOAMAOBSMN1; SMN2
SCHEMBL29793269 0.71 MAOB (0.47) CYP19A1PARP1MAOAMAOBSMN1; SMN2
SCHEMBL78594 0.71 MAOB (0.47) CYP19A1PARP1MAOAMAOBSMN1; SMN2
SCHEMBL28725626 0.70 CYP19A1 (0.54) CYP19A1PARP1MAOAMAOBSMN1; SMN2
SCHEMBL28725627 0.70 CYP19A1 (0.54) CYP19A1PARP1MAOAMAOBSMN1; SMN2

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2009071799-A1 PROCESS FOR THE SYNTHESIS OF 4-BENZOFURANCARBOXYLIC ACID ZACH SYSTEM (FR) 2009-06-11 WO disclosed
US-20090131688-A1 METHOD FOR THE SYNTHESIS OF 4-BENZOFURAN-CARBOXYLIC ACID ZACH SYSTEM (FR) 2009-05-21 US disclosed
US-20090131688-A1 METHOD FOR THE SYNTHESIS OF 4-BENZOFURAN-CARBOXYLIC ACID ZACH SYSTEM (FR) 2009-05-21 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20090131688-A1 METHOD FOR THE SYNTHESIS OF 4-BENZOFURAN-CARBOXYLIC ACID COASY, HSD17B12, ALDH18A1 PTPRF 4461/4885CYP19A1 7/4885PARP1 1500/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.